2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone

C15H22N2O3 — CID 71799552

IUPAC2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
SMILESCCOCC(=O)N1CCC(Oc2cccc(C)n2)CC1
InChIInChI=1S/C15H22N2O3/c1-3-19-11-15(18)17-9-7-13(8-10-17)20-14-6-4-5-12(2)16-14/h4-6,13H,3,7-11H2,1-2H3
InChIKeyCULWVWFLDZSXND-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.80
Rot. Bonds5

About 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone

2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone (PubChem CID 71799552) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
PubChem CID71799552
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
SMILESCCOCC(=O)N1CCC(Oc2cccc(C)n2)CC1
InChIInChI=1S/C15H22N2O3/c1-3-19-11-15(18)17-9-7-13(8-10-17)20-14-6-4-5-12(2)16-14/h4-6,13H,3,7-11H2,1-2H3
InChIKeyCULWVWFLDZSXND-UHFFFAOYSA-N
XLogP1.80
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[(1-Methylpyrrol-2-yl)methyl]piperazin-1-yl]-2-phenoxyethanone
CID 828791
N,N-Diethyl-2-(2-ethyl-6-methyl-pyridin-3-yloxy)-acetamide
CID 9549514
N-ethyl-N-(3-methylphenyl)-2-[[6-methyl-4-(trifluoromethyl)-2-pyridinyl]oxy]acetamide
CID 168271423
N-ethyl-N-(3-methylphenyl)-2-[(6-methyl-4-propan-2-yl-2-pyridinyl)oxy]acetamide
CID 168281454
2-[(3-cyano-4,6-dimethyl-2-pyridinyl)oxy]-N-ethyl-N-phenylacetamide
CID 17088130
US11072585, Example 41
CID 122536431
2-[(4,6-dimethyl-2-pyridinyl)oxy]-N-ethyl-N-(3-methylphenyl)acetamide
CID 168293683
N,N-diethyl-2-[(2-ethyl-6-methylpyridin-3-yl)oxy]acetamide
CID 567948
2-Piperidin-3-yloxy-6-(trifluoromethyl)pyridine
CID 62348720
2-Methyl-6-(piperidin-4-yloxy)pyridine dihydrochloride
CID 22499431
6-methyl-1H,2H,3H-pyrido(2,3-b)(1,4)oxazin-2-one
CID 66936595
2-(4-Methoxyphenoxy)-1-{4-[2-(pyridin-2-YL)ethyl]piperazin-1-YL}ethan-1-one
CID 16015758

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The IUPAC name of 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone (CID 71799552) is 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone.
What is the SMILES notation for 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The canonical SMILES for 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone is CCOCC(=O)N1CCC(Oc2cccc(C)n2)CC1.
What is the InChIKey of 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The InChIKey is CULWVWFLDZSXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-3-19-11-15(18)17-9-7-13(8-10-17)20-14-6-4-5-12(2)16-14/h4-6,13H,3,7-11H2,1-2H3.
What are the key properties of 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone has a molecular weight of 278.35 g/mol, XLogP of 1.80, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone is sourced from PubChem (CID 71799552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).